L-type amino acid transporter 1
Target ID: CHEMBL4459
Organism: Homo sapiens
Type: SINGLE PROTEIN
Molecules
| Name | SMILES | Bioactivity | Structure |
|---|---|---|---|
| HISTIDINE | N[C@@H](Cc1c[nH]cn1)C(=O)O | KA: 4.0 uM |  |
| ASPARTIC ACID | N[C@@H](CC(=O)O)C(=O)O | KA: 48.0 uM |  |
| LEVODOPA | N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O | IC50: 900000.0 nM |  |
| PHENYLALANINE | N[C@@H](Cc1ccccc1)C(=O)O | Solubility: 245000.0 ug.mL-1 |  |
Top Fragments
| SMILES | Avg pKi | Count | Structure |
|---|---|---|---|
| [8*]C[C@H](N)C(=O)O | 3.05 | 109 |  |
| c1ccccc1 | 3.05 | 73 |  |
| [16*]c1ccc(O)c(O)c1 | 3.05 | 39 |  |
| [14*]c1c[nH]cn1 | None | 36 |  |
| c1c[nH]cn1 | None | 36 |  |